Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Specifications
Specifications & Purity
Moligand™,≥97%
Biochemical and Physiological Mechanisms
CB-6644 is a selective inhibitor of RUVBL1 / 2 complex with anti-cancer activity. CB-6644 blocks the ATPase activity of RUVBL1/2 with an IC 50 of 15 nM.
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
INHIBITOR
Purity
≥97%
Names and Identifiers
Canonical Smiles
CCOC1=CC(=C(C=C1C(=O)NCC(C)(C)CC(=O)NC2=C(N3CCCC4=CC=CC=C4N3C2=O)COC)Cl)F
IUPAC Name
5-chloro-2-ethoxy-4-fluoro-N-[4-[[3-(methoxymethyl)-1-oxo-6,7-dihydro-5H-pyrazolo[1,2-a][1,2]benzodiazepin-2-yl]amino]-2,2-dimethyl-4-oxobutyl]benzamide
InChIKey
VYCOZEBCSAQCES-UHFFFAOYSA-N
INCHI
1S/C29H34ClFN4O5/c1-5-40-24-14-21(31)20(30)13-19(24)27(37)32-17-29(2,3)15-25(36)33-26-23(16-39-4)34-12-8-10-18-9-6-7-11-22(18)35(34)28(26)38/h6-7,9,11,13-14H,5,8,10,12,15-17H2,1-4H3,(H,32,37)(H,33,36)
Isomeric SMILES
CCOC1=CC(=C(C=C1C(=O)NCC(C)(C)CC(=O)NC2=C(N3CCCC4=CC=CC=C4N3C2=O)COC)Cl)F
PubChem CID
137333455
Molecular Weight
573.06
Advanced Data
3D Structure
Interactive Chemical Structure Model
Associated Targets(Human)
A549 (127892 Activities)
HCT-116 (91556 Activities)
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MDA-MB-231 (73002 Activities)
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RUVBL2 Tbio RuvB-like 2 (47 Activities)
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Mechanisms of Action
Certificates (CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 I2618389 | Certificate of Analysis | Apr 18, 2026 | C650122 |
| I2618390 | Certificate of Analysis | Apr 18, 2026 | C650122 |
| I2618391 | Certificate of Analysis | Apr 18, 2026 | C650122 |
| I2618392 | Certificate of Analysis | Apr 18, 2026 | C650122 |
| I2618393 | Certificate of Analysis | Apr 18, 2026 | C650122 |
Chemical and Physical Properties
| Solubility | DMSO : 100 mg/mL (174.50 mM; Need ultrasonic) |
|---|---|
| Molecular Weight | 573.100 g/mol |
| XLogP3 | 4.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 10 |
| Exact Mass | 572.22 Da |
| Monoisotopic Mass | 572.22 Da |
| Topological Polar Surface Area | 100.000 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 978.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Solution Calculators
Reviews
Customer Reviews
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